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2-Betenoic acid, 2-(hydroxymethyl)-, 4,5,6,7,8,9-hexahydro-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-8a(4ah)-yl ester, [4ar-(4a.alpha.,5.alpha.,8a.alpha.)]-
SpectraBase Compound ID mpYIpbp6nm
InChI InChI=1S/C20H26O5/c1-5-14(10-21)18(23)25-20-8-6-7-13(3)19(20,4)9-15-12(2)11-24-16(15)17(20)22/h5,11,13,21H,6-10H2,1-4H3/b14-5+
InChIKey MYIQFJLKAWXIDD-LHHJGKSTSA-N
Mol Weight 346.42 g/mol
Molecular Formula C20H26O5
Exact Mass 346.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JMF0f6lLyD
Name 2-Betenoic acid, 2-(hydroxymethyl)-, 4,5,6,7,8,9-hexahydro-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-8a(4ah)-yl ester, [4ar-(4a.alpha.,5.alpha.,8a.alpha.)]-
Alternate Name(s) 3,4a,5-Trimethyl-9-oxo-4,5,6,7,8,9-hexahydronaphtho[2,3-b]furan-8a(4ah)-yl (2E)-2-(hydroxymethyl)-2-butenoate (3,4a,5-trimethyl-9-oxidanylidene-5,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-8a-yl) (E)-2-(hydroxymethyl)but-2-enoate (3,4a,5-trimethyl-9-oxo-5,6,7,8-tetrahydro-4H-benzo[f]benzofuran-8a-yl) (E)-2-(hydroxymethyl)but-2-enoate (3,4a,5-trimethyl-9-oxo-5,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-8a-yl) (E)-2-(hydroxymethyl)but-2-enoate (E)-2-(hydroxymethyl)-2-butenoic acid (3,4a,5-trimethyl-9-oxo-5,6,7,8-tetrahydro-4H-benzo[f]benzofuran-8a-yl) ester (E)-2-methylolbut-2-enoic acid (9-keto-3,4a,5-trimethyl-5,6,7,8-tetrahydro-4H-benzo[f]benzofuran-8a-yl) ester
CAS Registry Number 56196-60-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O5
InChI InChI=1S/C20H26O5/c1-5-14(10-21)18(23)25-20-8-6-7-13(3)19(20,4)9-15-12(2)11-24-16(15)17(20)22/h5,11,13,21H,6-10H2,1-4H3/b14-5+
InChIKey MYIQFJLKAWXIDD-LHHJGKSTSA-N
Molecular Weight 346.423 g/mol
SMILES OC\C(=C/C)C(=O)OC12CCCC(C)C2(C)Cc2c(occ2C)C1=O
SPLASH splash10-03ea-5961000000-d0a70e35e6466ab96a18
Source of Spectrum EP-2888-0-0
Wiley ID 1339349